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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL420144
Molecular formula	C23H29NO3S
IUPAC name	(1S,4R)-7,7-dimethyl-1-(spiro[indene-1,4'-piperidine]-1'-ylsulfonylmethyl)bicyclo[2.2.1]heptan-2-one
Molecular weight	399.549
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.7
Synonyms	7,7-dimethyl-1-spiro[1H-indene-1,4''-(hexahydropyridine)]-1-ylsulfonylmethyl-(1S,4R)-bicyclo[2.2.1]heptan-2-one 1-[[[(1S,4R)-7,7-Dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl]methyl]sulfonyl]spiro[piperidine-4,1'-[1H]indene] BDBM50043135
Inchi Key	AAIYKQCKJSUOEL-WZONZLPQSA-N
Inchi ID	InChI=1S/C23H29NO3S/c1-21(2)18-8-10-23(21,20(25)15-18)16-28(26,27)24-13-11-22(12-14-24)9-7-17-5-3-4-6-19(17)22/h3-7,9,18H,8,10-16H2,1-2H3/t18-,23-/m1/s1
PubChem CID	10069537
ChEMBL	CHEMBL420144
IUPHAR	N/A
BindingDB	50043135
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
246	Oxytocin receptor	P70536	Oxtr	Rattus norvegicus (Rat)	388
245	Vasopressin V2 receptor	Q00788	Avpr2	Rattus norvegicus (Rat)	371

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